SCHEMBL23638633

SCHEMBL23638633

CCCCC(C)(C)c1nnc2n1CCC2

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.39
HSD11B2 P80365 1/20 0.39
POLB P06746 2/20 0.38
ALDH1A1 P00352 2/20 0.35
TSHR P16473 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C19 P33261 1/20 0.35
HPGD P15428 3/20 0.34
KDM4E B2RXH2 1/20 0.32
BCHE P06276 4/20 0.32
ACHE P22303 4/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL23638561 0.90 POLB (0.40) HSD11B1HSD11B2POLBALDH1A1TSHR
SCHEMBL23638642 0.83 POLB (0.42) HSD11B1HSD11B2POLBALDH1A1TSHR
SCHEMBL23638713 0.79
SCHEMBL23638716 0.73 POLB (0.44) HSD11B1HSD11B2POLBALDH1A1TSHR
SCHEMBL14030286 0.71 POLB (0.55) HSD11B1HSD11B2POLBALDH1A1TSHR
SCHEMBL14030255 0.69 POLB (0.58) HSD11B1HSD11B2POLBALDH1A1TSHR
SCHEMBL23638651 0.69
SCHEMBL8367476 0.66 KDM4E (0.47) POLBTSHRHPGDKDM4E
SCHEMBL14048238 0.65 POLB (0.47) POLBTSHRKDM4E
SCHEMBL7768463 0.65 MAPT (0.46) POLBTSHRKDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210213006-A1 METHODS OF TREATING NEURODEGENERATIVE DISEASES Seal Rock Therapeutics, Inc. 2021-07-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210213006-A1 METHODS OF TREATING NEURODEGENERATIVE DISEASES SNCA, MAPT, HTT HSD11B1 1901/4885HSD11B2 2684/4885POLB 2382/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.